2-[[(5-chloranyl-2-methoxy-phenyl)sulfonyl-methyl-amino]methyl]-5-methyl-2-piperidin-1-ylcarbonyl-hexanoic acid

Systemtic Name: 2-[[(5-chloranyl-2-methoxy-phenyl)sulfonyl-methyl-amino]methyl]-5-methyl-2-piperidin-1-ylcarbonyl-hexanoic acid Openeye Name: 2-[[(5-chloro-2-methoxy-phenyl)sulfonyl-methyl-amino]methyl]-5-methyl-2-(piperidine-1-carbonyl)hexanoic acid CAS Name: 2-[[(5-chloro-2-methoxyphenyl)sulfonyl-methylamino]methyl]-5-methyl-2-[oxo(1-piperidinyl)methyl]hexanoic acid IUPAC Name: 2-[[(5-chloro-2-methoxyphenyl)sulfonyl-methylamino]methyl]-5-methyl-2-(piperidine-1-carbonyl)hexanoic acid Traditional Name: 2-[[(5-chloro-2-methoxy-phenyl)sulfonyl-methyl-amino]methyl]-5-methyl-2-(piperidine-1-carbonyl)hexanoic acid Formula: C22H33ClN2O6S MolecularWeight: 489.02522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(CN(C)S(=O)(=O)C1=C(C=CC(=C1)Cl)OC)(C(=O)N2CCCCC2)C(=O)O

Isomeric SMILES

CC(C)CCC(CN(C)S(=O)(=O)C1=C(C=CC(=C1)Cl)OC)(C(=O)N2CCCCC2)C(=O)O

InChI

InChI=1S/C22H33ClN2O6S/c1-16(2)10-11-22(21(27)28,20(26)25-12-6-5-7-13-25)15-24(3)32(29,30)19-14-17(23)8-9-18(19)31-4/h8-9,14,16H,5-7,10-13,15H2,1-4H3,(H,27,28)